AB63072
392-12-1 | Indole-3-pyruvic acid
Manufacturer: A2B Chem
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CatalogNumber
AB63072
ChemicalName
Indole-3-pyruvic acid
CasNumber
392-12-1
MolecularFormula
C11H9NO3
MolecularWeight
203.1941
MdlNumber
MFCD00005640
Smiles
OC(=O)C(=O)Cc1c[nH]c2c1cccc2
NscNumber
88874
Complexity
277
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
1.3
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CatalogNumber: AB63072
ChemicalName: Indole-3-pyruvic acid
CasNumber: 392-12-1
MolecularFormula: C11H9NO3
MolecularWeight: 203.1941
MdlNumber: MFCD00005640
Smiles: OC(=O)C(=O)Cc1c[nH]c2c1cccc2
NscNumber: 88874
Complexity: 277
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: 1.3
CatalogNumber:
AB63072
ChemicalName:
Indole-3-pyruvic acid
CasNumber:
392-12-1
MolecularFormula:
C11H9NO3
MolecularWeight:
203.1941
MdlNumber:
MFCD00005640
Smiles:
OC(=O)C(=O)Cc1c[nH]c2c1cccc2
NscNumber:
88874
Complexity:
277
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
1.3
CatalogNumber: AB63073
ChemicalName: 1H-Indole-3-propanol
CasNumber: 3569-21-9
MolecularFormula: C11H13NO
MolecularWeight: 175.227
MdlNumber: MFCD00013437
Smiles: OCCCc1c[nH]c2c1cccc2
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AB63073
ChemicalName:
1H-Indole-3-propanol
CasNumber:
3569-21-9
MolecularFormula:
C11H13NO
MolecularWeight:
175.227
MdlNumber:
MFCD00013437
Smiles:
OCCCc1c[nH]c2c1cccc2
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AB63074
ChemicalName: 3-(1H-Indol-4-yl)benzoic acid
CasNumber: 442562-80-3
MolecularFormula: C15H11NO2
MolecularWeight: 237.2533
MdlNumber: MFCD13177530
Smiles: OC(=O)c1cccc(c1)c1cccc2c1cc[nH]2
NscNumber: __
Complexity: 318
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 2
Xlogp3: 3.2
CatalogNumber:
AB63074
ChemicalName:
3-(1H-Indol-4-yl)benzoic acid
CasNumber:
442562-80-3
MolecularFormula:
C15H11NO2
MolecularWeight:
237.2533
MdlNumber:
MFCD13177530
Smiles:
OC(=O)c1cccc(c1)c1cccc2c1cc[nH]2
NscNumber:
__
Complexity:
318
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
2
Xlogp3:
3.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)c1cccc(c1)c1ccc2c(c1)cc[nH]2
NscNumber: __
Complexity: 318
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 3.5
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)c1cccc(c1)c1ccc2c(c1)cc[nH]2
NscNumber:
__
Complexity:
318
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
3.5